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canSAR2280618
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NAMES
    SMILES
    Cc1c(Sc2cccc(C(=O)O)c2)c2ccc(Cl)cc2n1C
    InChI
    InChI=1S/C17H14ClNO2S/c1-10-16(14-7-6-12(18)9-15(14)19(10)2)22-13-5-3-4-11(8-13)17(20)21/h3-9H,1-2H3,(H,20,21)
    MOLECULAR FORMULA
    C17H14ClNO2S
    CROSS REFERENCES
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    canSAR2280618

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.04
    AlogP 4.99
    HBond donors 1
    HBond acceptors 3
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2280618.